Geometry & MOs

Info

ID:	331837
PubChem CID:	127250123
Reduced:	N2O2C12H15 (2)
Stoich.:	A2B2C12D15 (2)
Weight, g/mol:	436.211055
ΔH_f, kcal/mol:	-116.81
Dipole, Da:	2.08
IP(EA), eV:	-8.6(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[6-[(4-ethoxyphenyl)methyl]pyridin-2-yl]morpholin-4-yl]-3-(3-methyl-1,2,4-oxadiazol-5-yl)propan-1-one

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC2=NC(=CC=C2)C3CN(CCO3)C(=O)CN4CCNC(=O)C4

DOS

IR

Vibrations